SCHEMBL3782915

SCHEMBL3782915

c1ccc(Cc2ccc(OC3CCNCC3)c3ncccc23)cc1

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 5/20 0.60
PAX8 Q06710 1/20 0.51
NMT1 P30419 8/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3792388 0.78 SLC6A2 (0.48) HRH1
SCHEMBL3714344 0.78 SLC6A2 (0.44) HRH1
SCHEMBL3786278 0.77 HRH1 (0.53) HRH1NMT1
SCHEMBL30735992 0.74 MAPT (0.48) HRH1
SCHEMBL19297264 0.74 MAPT (0.48) HRH1
SCHEMBL3790744 0.72 HRH1 (0.48) HRH1
Hydrochloric Acid SCHEMBL23360094 0.72 IRAK1 (0.45) HRH1
SCHEMBL3715640 0.72 DDB1 (0.53) HRH1
SCHEMBL3791590 0.70 HTR1A (0.45) HRH1
Hydrochloric Acid SCHEMBL23360018 0.70 SLC40A1 (0.47)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010094643-A1 QUINOLINE DERIVATIVES AND THEIR USES FOR RHINITIS AND URTICARIA GLAXO GROUP LIMITED (GB) 2010-08-26 WO disclosed